SCHEMBL6820238

SCHEMBL6820238

Cc1ccc2c(c1)C(C)C(C)C1=CC(=O)CCN12

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 14/20 0.62
KMT2A Q03164 1/20 0.35
HTR7 P34969 1/20 0.34
HTR2B P41595 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HSD17B10 Q99714 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6819931 0.85 SRD5A1 (0.63) SRD5A1KMT2A
SCHEMBL6815448 0.81 SRD5A1 (0.45) SRD5A1KMT2A
SCHEMBL6820079 0.77 SRD5A1 (1.00) SRD5A1KMT2A
SCHEMBL6820284 0.77 SRD5A1 (0.74) SRD5A1
SCHEMBL6819779 0.75 SRD5A1 (0.62) SRD5A1KMT2A
SCHEMBL6820263 0.67 SRD5A1 (1.00) SRD5A1
SCHEMBL6820361 0.66 SRD5A1 (1.00) SRD5A1
SCHEMBL6819781 0.65 SRD5A1 (1.00) SRD5A1
SCHEMBL6820470 0.63 SRD5A1 (0.67) SRD5A1
SCHEMBL6819849 0.62 SRD5A1 (1.00) SRD5A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1102765-B1 PROCESS FOR THE SYNTHESIS OF (1$i(H))-BENZO C]QUINOLIZIN-3-ONES DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2003-09-17 EP claimed
US-6723850-B1 N-ALKYLATION OF THE THIOAMIDE WITH A VINYL KETONE IN PRESENCE OF A STRONG BASE; 6-CHLORO-(1H)-3,4-DIHYDROQUINOLIN-2-THIONE REACTED WITH ETHYL VINYL KETONE APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-04-20 US disclosed
EP-1102765-B1 PROCESS FOR THE SYNTHESIS OF (1$i(H))-BENZO C]QUINOLIZIN-3-ONES DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2003-09-17 EP disclosed